Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTYVEMKDVSKYYQMGENVVTANDKITFGIKKGEFVVIVGPSGAGKSTVLNILGGMDSASEGKIMVDGQDIAQYNAKQLTKYRRTDVGFVFQFYNLVPNLTAKENVELAAQIAPNALDAETVLTQVGLSHRLDNFP--------------AQLSGGEQQRVAIARALAKAPKLLLCDEPTGALDYDTGKSVLKLLQETCRNTGTTVIVITHNTAITPIADRIIEINNAKVRSIKENPEPMSIDDLEW
2PMK Chain:A ((22-228))
-----------------------DNINLSIKQGEVIGIVGRSGSGKSTLTKLIQRFYIPENGQVLIDGHDLALADPNWL----RRQVGVVLQD-NVLLNRSIIDNISLANP----GMSVEKVIYAAKLAGAHDFISELREGYNTIVGEQGAGLSGGQRQRIAIARALVNNPKILIFDEATSALDYESEHVIMRNMHKICK--GRTVIIIAHRLSTVKNADRIIVMEKGKIVEQGKHKELLS------
General information:
TITO was launched using:
RESULT:
Template:
2PMK.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -87337 for 1423 contacts (-61.4/contact) +
2D Compatibility (PS) -20491 + (NN) -7166 + (LL) 2924
1D Compatibility (HY) -16400 + (ID) 3650
Total energy: -132120.0 ( -92.85 by residue)
QMean score : 0.517
(partial model without unconserved sides chains):
PDB file :
Tito_2PMK.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2PMK-query.scw
PDB file :
Tito_Scwrl_2PMK.pdb
: